Geometry & MOs

Info

ID:	12747
PubChem CID:	144897
Reduced:	OC4H7 (2)
Stoich.:	AB4C7 (2)
Weight, g/mol:	142.09938
ΔH_f, kcal/mol:	-94.75
Dipole, Da:	1.75
IP(EA), eV:	-10.61(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3,3-dimethyl-2-methylidenebutanoate

Drug info:

PubChemData

Smile

CC(C)(C)C(=C)C(=O)OC

DOS

IR

Vibrations